#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2djv n SER 2 N 0.00 -4.63 -4.36 1.61 7.64 -1.26 -2.31 113.62 110.31 2djv n SER 2 Ca 0.00 -0.56 -0.39 0.00 1.01 0.00 0.00 58.87 58.93 2djv n SER 2 Cb 0.00 -4.96 -0.08 0.00 -1.01 0.00 0.00 64.21 58.17 2djv n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2djv n SER 3 N -2.97 -1.44 -4.07 6.43 2.88 -1.26 -4.89 113.62 108.30 2djv n SER 3 Ca -0.10 -1.18 -0.30 0.00 -1.33 0.00 0.00 58.87 55.96 2djv n SER 3 Cb 0.60 -1.51 -0.17 0.00 -0.75 0.00 0.00 64.21 62.38 2djv n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2djv s GLY 4 N -3.25 1.12 -0.04 0.46 0.00 -0.98 -5.09 107.32 99.54 2djv s GLY 4 Ca 0.71 -0.84 -0.29 0.00 0.00 0.00 0.00 44.72 44.29 2djv s GLY 4 CO 0.97 0.24 2.03 -0.45 0.00 0.00 0.00 173.10 175.89 2djv s SER 5 N 1.06 6.17 0.39 1.64 0.15 -1.26 -4.91 113.70 116.94 2djv s SER 5 Ca -0.04 2.44 0.04 0.00 0.70 0.00 0.00 55.95 59.08 2djv s SER 5 Cb -0.15 -2.52 -0.03 0.00 -1.71 0.00 0.00 66.02 61.61 2djv s SER 5 CO -0.04 -1.31 0.12 -0.94 1.20 0.00 0.00 173.24 172.28 2djv s SER 6 N 5.50 2.65 0.00 5.45 1.04 -1.26 -5.13 113.70 121.95 2djv s SER 6 Ca 0.91 -1.63 0.00 0.00 0.48 0.00 0.00 55.95 55.72 2djv s SER 6 Cb -0.40 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.15 2djv s SER 6 CO 0.39 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 174.34 2djv n GLY 7 N -0.86 0.45 3.58 7.32 0.00 -1.26 -4.98 105.19 109.45 2djv n GLY 7 Ca -0.05 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 2djv n GLY 7 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2djv n THR 8 N 0.00 -0.02 -0.58 2.61 5.66 -1.26 -4.81 114.28 115.87 2djv n THR 8 Ca 0.00 -0.01 -0.30 0.00 -3.05 0.00 0.00 64.05 60.69 2djv n THR 8 Cb 0.00 -0.35 0.21 0.00 -1.55 0.00 0.00 70.33 68.64 2djv n THR 8 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2djv n THR 9 N -2.94 0.00 -3.48 1.09 -2.24 -1.26 -5.05 114.28 100.39 2djv n THR 9 Ca 0.07 -0.34 -0.13 0.00 -2.27 0.00 0.00 64.05 61.37 2djv n THR 9 Cb 0.31 -0.84 -0.04 0.00 -2.10 0.00 0.00 70.33 67.67 2djv n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2djv s ALA 10 N -2.37 -1.53 -0.02 6.98 0.00 -1.26 -5.04 121.76 118.53 2djv s ALA 10 Ca 0.63 0.62 -0.20 0.00 0.00 0.00 0.00 51.96 53.02 2djv s ALA 10 Cb -0.20 0.62 -0.11 0.00 0.00 0.00 0.00 23.12 23.43 2djv s ALA 10 CO 0.65 -0.64 0.82 0.87 0.00 0.00 0.00 175.76 177.46 2djv h LYS 11 N 2.35 -0.69 0.00 0.00 1.79 -1.98 -0.56 116.57 117.48 2djv h LYS 11 Ca -0.32 0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 2djv h LYS 11 Cb 1.26 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 32.06 2djv h LYS 11 CO 0.39 -0.46 0.00 -0.35 -1.08 0.00 0.00 179.45 177.96 2djv n PRO 12 N -5.25 0.45 -0.12 3.15 -0.04 -1.26 -3.04 135.00 128.90 2djv n PRO 12 Ca -0.09 0.02 -0.23 0.00 -0.04 0.00 0.00 63.50 63.16 2djv n PRO 12 Cb 0.28 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.15 2djv n PRO 12 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2djv n GLN 13 N -1.04 0.52 -0.13 0.54 1.13 -1.19 -4.49 117.38 112.72 2djv n GLN 13 Ca 0.11 0.20 0.09 0.00 -1.94 0.00 0.00 57.00 55.47 2djv n GLN 13 Cb 0.06 -1.38 0.43 0.00 0.11 0.00 0.00 30.24 29.47 2djv n GLN 13 CO 0.00 0.00 0.00 -0.56 -1.44 0.00 0.00 177.06 175.06 2djv h GLN 14 N -0.65 0.55 0.20 -1.09 3.07 -1.01 -2.73 115.11 113.45 2djv h GLN 14 Ca -0.59 -0.03 0.01 0.00 0.09 0.00 0.00 58.65 58.13 2djv h GLN 14 Cb 1.59 -0.12 -0.04 0.00 0.08 0.00 0.00 27.48 28.99 2djv h GLN 14 CO -0.30 0.37 -0.50 0.82 0.09 0.00 0.00 178.83 179.30 2djv h ILE 15 N 0.57 0.04 -1.13 1.86 2.04 -1.77 0.93 117.51 120.05 2djv h ILE 15 Ca 0.30 0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.47 2djv h ILE 15 Cb 0.41 0.04 -0.08 0.00 -0.74 0.00 0.00 36.82 36.45 2djv h ILE 15 CO -0.09 0.00 0.76 -0.61 0.00 0.00 0.00 178.15 178.21 2djv h GLN 16 N -0.79 0.21 0.10 2.37 5.75 -1.71 0.42 115.11 121.46 2djv h GLN 16 Ca -0.01 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2djv h GLN 16 Cb 0.77 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.27 2djv h GLN 16 CO -0.23 0.14 -0.05 0.00 -2.65 0.00 0.00 178.83 176.04 2djv h ALA 17 N 1.54 -0.13 -0.35 3.38 0.00 -1.14 -3.27 119.26 119.30 2djv h ALA 17 Ca 0.61 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 55.32 2djv h ALA 17 Cb 1.91 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 19.69 2djv h ALA 17 CO -0.21 -0.24 0.00 -0.07 0.00 0.00 0.00 179.25 178.73 2djv h LEU 18 N -0.79 -0.14 -0.87 0.00 3.38 0.73 -2.06 115.31 115.57 2djv h LEU 18 Ca -0.01 0.08 0.18 0.00 0.09 0.00 0.00 57.88 58.22 2djv h LEU 18 Cb 0.58 0.14 -0.16 0.00 0.09 0.00 0.00 40.66 41.30 2djv h LEU 18 CO 0.02 -0.03 -0.18 0.24 0.09 0.00 0.00 178.44 178.58 2djv h MET 19 N 0.10 0.01 -0.56 1.13 2.86 -1.09 0.65 114.93 118.02 2djv h MET 19 Ca 0.17 -0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.73 2djv h MET 19 Cb 0.23 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2djv h MET 19 CO -0.28 0.01 0.05 0.22 1.06 0.00 0.00 176.91 177.96 2djv h ASP 20 N 0.01 0.88 -0.36 1.22 1.82 -1.44 -2.79 116.42 115.76 2djv h ASP 20 Ca 0.43 -0.21 0.03 0.00 -0.39 0.00 0.00 57.03 56.89 2djv h ASP 20 Cb 0.69 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 40.43 2djv h ASP 20 CO -0.88 0.91 0.16 -0.33 -1.61 0.00 0.00 179.24 177.50 2djv h GLU 21 N 0.86 0.33 -0.24 0.28 4.39 0.77 0.20 114.58 121.17 2djv h GLU 21 Ca 0.17 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.86 2djv h GLU 21 Cb 0.44 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 2djv h GLU 21 CO 0.02 0.22 0.13 0.28 -1.16 0.00 0.00 179.01 178.50 2djv h VAL 22 N 0.34 1.02 0.32 3.13 2.07 -0.98 0.27 116.25 122.42 2djv h VAL 22 Ca 0.16 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.57 2djv h VAL 22 Cb 0.09 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 2djv h VAL 22 CO -0.13 0.05 -0.15 0.74 0.02 0.00 0.00 177.57 178.10 2djv h THR 23 N 0.28 0.71 0.79 2.57 2.02 -1.21 -2.09 112.91 115.98 2djv h THR 23 Ca 0.10 -0.31 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 2djv h THR 23 Cb 0.00 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 2djv h THR 23 CO -0.05 0.06 -0.49 0.50 0.37 0.00 0.00 175.52 175.92 2djv h LYS 24 N -0.59 -1.15 -0.87 6.66 3.64 -0.54 -1.99 116.57 121.73 2djv h LYS 24 Ca -0.04 0.08 0.22 0.00 -1.27 0.00 0.00 60.65 59.64 2djv h LYS 24 Cb 0.43 0.26 -0.15 0.00 -0.41 0.00 0.00 32.23 32.36 2djv h LYS 24 CO 0.07 -0.77 0.10 0.37 -2.27 0.00 0.00 179.45 176.96 2djv h GLN 25 N -1.19 0.11 -0.63 1.90 5.75 -0.52 0.54 115.11 121.07 2djv h GLN 25 Ca -0.10 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.37 2djv h GLN 25 Cb 0.96 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.45 2djv h GLN 25 CO 0.11 0.07 0.31 0.78 -2.65 0.00 0.00 178.83 177.45 2djv h GLY 26 N 0.12 0.95 1.05 2.39 0.00 -1.09 -2.63 103.07 103.86 2djv h GLY 26 Ca 0.52 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 47.31 2djv h GLY 26 CO -0.73 0.42 -0.10 3.43 0.00 0.00 0.00 176.54 179.55 2djv h ASN 27 N 0.88 0.94 -0.86 0.19 2.35 0.78 -2.80 115.58 117.06 2djv h ASN 27 Ca 0.22 -0.35 0.08 0.00 -0.55 0.00 0.00 56.30 55.69 2djv h ASN 27 Cb 0.08 -0.26 -0.06 0.00 0.05 0.00 0.00 38.32 38.13 2djv h ASN 27 CO -0.03 1.08 0.56 0.40 -1.65 0.00 0.00 177.43 177.79 2djv h ILE 28 N 0.79 1.02 -0.46 2.81 2.04 -0.85 -0.71 117.51 122.16 2djv h ILE 28 Ca 0.13 -0.31 -0.12 0.00 1.00 0.00 0.00 64.86 65.55 2djv h ILE 28 Cb 0.65 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2djv h ILE 28 CO 0.05 0.17 -0.20 0.58 0.00 0.00 0.00 178.15 178.74 2djv h VAL 29 N 0.92 1.27 0.54 1.67 2.07 -1.33 -0.98 116.25 120.41 2djv h VAL 29 Ca 0.38 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 2djv h VAL 29 Cb 0.29 1.17 0.01 0.00 -1.52 0.00 0.00 31.29 31.24 2djv h VAL 29 CO -0.15 0.46 -0.26 -0.09 0.02 0.00 0.00 177.57 177.56 2djv h ARG 30 N 0.78 -0.70 -0.62 1.57 2.43 -1.07 -2.60 114.38 114.17 2djv h ARG 30 Ca 0.10 0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.36 2djv h ARG 30 Cb 0.77 0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.44 2djv h ARG 30 CO 0.06 -0.39 0.41 1.05 -1.51 0.00 0.00 179.97 179.59 2djv h GLU 31 N -0.96 0.68 -0.32 0.20 -0.00 -1.22 -2.19 114.58 110.77 2djv h GLU 31 Ca -0.07 -0.04 0.03 0.00 -0.00 0.00 0.00 59.36 59.27 2djv h GLU 31 Cb 0.63 -0.15 -0.03 0.00 -0.00 0.00 0.00 28.75 29.19 2djv h GLU 31 CO 0.12 0.45 0.13 -0.07 -0.00 0.00 0.00 179.01 179.65 2djv h LEU 32 N 0.71 0.18 -0.52 3.06 3.38 -1.08 -1.49 115.31 119.54 2djv h LEU 32 Ca 0.25 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 2djv h LEU 32 Cb 0.12 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2djv h LEU 32 CO -0.07 0.14 0.17 0.11 0.09 0.00 0.00 178.44 178.87 2djv h LYS 33 N 0.29 0.80 -0.84 1.13 1.57 -1.01 -0.98 116.57 117.53 2djv h LYS 33 Ca 0.14 -0.17 0.08 0.00 -1.87 0.00 0.00 60.65 58.83 2djv h LYS 33 Cb 0.08 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.22 2djv h LYS 33 CO -0.12 0.74 0.54 0.00 -0.57 0.00 0.00 179.45 180.04 2djv h ALA 34 N 1.02 1.63 -0.31 3.86 0.00 -1.02 0.06 119.26 124.51 2djv h ALA 34 Ca 0.17 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 2djv h ALA 34 Cb 0.27 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 2djv h ALA 34 CO -0.01 0.23 0.16 1.04 0.00 0.00 0.00 179.25 180.67 2djv n GLN 35 N -4.50 1.79 -4.43 0.00 6.02 -0.60 -4.86 117.38 110.81 2djv n GLN 35 Ca 0.13 -1.10 -0.38 0.00 -0.01 0.00 0.00 57.00 55.64 2djv n GLN 35 Cb 0.25 -1.55 -0.08 0.00 1.02 0.00 0.00 30.24 29.88 2djv n GLN 35 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2djv n LYS 36 N 0.02 -1.06 -1.48 -1.09 4.76 0.01 -4.86 118.16 114.45 2djv n LYS 36 Ca 0.18 0.15 -0.33 0.00 -2.87 0.00 0.00 58.31 55.44 2djv n LYS 36 Cb 0.81 -4.36 0.08 0.00 -1.84 0.00 0.00 35.03 29.72 2djv n LYS 36 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2djv s ALA 37 N -3.66 2.22 0.25 7.82 0.00 -0.40 -4.93 121.76 123.06 2djv s ALA 37 Ca 0.52 0.64 -0.31 0.00 0.00 0.00 0.00 51.96 52.81 2djv s ALA 37 Cb -0.30 -3.38 -0.12 0.00 0.00 0.00 0.00 23.12 19.32 2djv s ALA 37 CO 1.01 -1.70 1.68 0.34 0.00 0.00 0.00 175.76 177.09 2djv s ASP 38 N -2.48 6.36 0.22 0.00 -1.08 -1.26 -4.84 116.67 113.58 2djv s ASP 38 Ca 0.69 2.92 -0.11 0.00 -0.52 0.00 0.00 52.55 55.53 2djv s ASP 38 Cb -0.23 -2.62 0.31 0.00 -1.46 0.00 0.00 42.92 38.92 2djv s ASP 38 CO 0.46 -0.96 1.64 0.50 0.52 0.00 0.00 175.17 177.33 2djv h LYS 39 N 5.94 0.07 -0.77 4.34 3.64 -1.99 0.11 116.57 127.92 2djv h LYS 39 Ca -0.45 -0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.00 2djv h LYS 39 Cb 1.21 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.95 2djv h LYS 39 CO 0.89 0.04 0.44 -0.91 -2.27 0.00 0.00 179.45 177.64 2djv h ASN 40 N 0.07 0.66 -0.43 4.20 2.35 -1.99 0.19 115.58 120.62 2djv h ASN 40 Ca 0.34 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 56.12 2djv h ASN 40 Cb 0.55 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.80 2djv h ASN 40 CO -0.61 0.41 0.25 -0.33 -1.65 0.00 0.00 177.43 175.50 2djv h GLU 41 N 0.79 0.59 0.19 0.81 4.39 -1.19 -2.66 114.58 117.49 2djv h GLU 41 Ca 0.35 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.98 2djv h GLU 41 Cb 0.24 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2djv h GLU 41 CO -0.20 0.45 -0.09 0.28 -1.16 0.00 0.00 179.01 178.28 2djv h VAL 42 N 0.57 0.91 -0.79 3.13 2.07 -0.53 -3.25 116.25 118.36 2djv h VAL 42 Ca 0.15 -0.65 0.10 0.00 0.82 0.00 0.00 66.70 67.12 2djv h VAL 42 Cb 0.01 1.29 -0.12 0.00 -1.52 0.00 0.00 31.29 30.96 2djv h VAL 42 CO -0.03 0.15 -0.49 0.00 0.02 0.00 0.00 177.57 177.22 2djv h ALA 43 N 0.13 -0.34 -0.83 1.67 0.00 -0.60 0.21 119.26 119.51 2djv h ALA 43 Ca -0.03 0.14 0.13 0.00 0.00 0.00 0.00 54.91 55.16 2djv h ALA 43 Cb 0.43 1.13 -0.14 0.00 0.00 0.00 0.00 17.79 19.21 2djv h ALA 43 CO 0.04 -0.85 -0.38 0.00 0.00 0.00 0.00 179.25 178.06 2djv h ALA 44 N 0.68 0.05 -0.30 0.00 0.00 -1.52 0.15 119.26 118.32 2djv h ALA 44 Ca 0.20 0.23 0.05 0.00 0.00 0.00 0.00 54.91 55.39 2djv h ALA 44 Cb 0.52 0.94 -0.05 0.00 0.00 0.00 0.00 17.79 19.20 2djv h ALA 44 CO -0.83 -0.66 0.02 0.93 0.00 0.00 0.00 179.25 178.71 2djv h GLU 45 N -0.07 0.11 -0.08 0.00 4.39 -1.03 -2.83 114.58 115.08 2djv h GLU 45 Ca 0.30 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 60.02 2djv h GLU 45 Cb 0.58 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.14 2djv h GLU 45 CO -0.87 0.07 -0.46 0.28 -1.16 0.00 0.00 179.01 176.88 2djv h VAL 46 N 0.11 0.10 -0.96 3.13 2.07 0.22 -2.01 116.25 118.91 2djv h VAL 46 Ca 0.15 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.82 2djv h VAL 46 Cb 0.19 0.10 -0.16 0.00 -1.52 0.00 0.00 31.29 29.90 2djv h VAL 46 CO -0.23 0.00 -0.35 0.00 0.02 0.00 0.00 177.57 177.01 2djv n ALA 47 N -2.94 -0.06 0.13 1.67 0.00 -0.52 -0.36 120.51 118.43 2djv n ALA 47 Ca -0.05 0.97 -0.13 0.00 0.00 0.00 0.00 53.44 54.23 2djv n ALA 47 Cb 0.37 -0.46 -0.06 0.00 0.00 0.00 0.00 19.45 19.31 2djv n ALA 47 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2djv h LYS 48 N 0.00 -0.47 -0.62 0.00 3.64 -1.30 -2.62 116.57 115.20 2djv h LYS 48 Ca 0.35 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.89 2djv h LYS 48 Cb 0.59 0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 32.40 2djv h LYS 48 CO -0.96 -0.32 -0.17 1.25 -2.27 0.00 0.00 179.45 176.98 2djv h LEU 49 N -0.49 -0.64 -0.82 5.20 5.85 -0.09 0.74 115.31 125.06 2djv h LEU 49 Ca 0.02 0.19 0.20 0.00 0.84 0.00 0.00 57.88 59.13 2djv h LEU 49 Cb 0.50 0.41 -0.14 0.00 0.37 0.00 0.00 40.66 41.79 2djv h LEU 49 CO -0.13 -0.22 0.07 -0.07 -0.34 0.00 0.00 178.44 177.76 2djv h LEU 50 N -0.02 -0.26 0.23 2.25 3.38 -0.78 -0.56 115.31 119.54 2djv h LEU 50 Ca 0.29 0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.46 2djv h LEU 50 Cb 0.47 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2djv h LEU 50 CO -0.64 -0.19 -0.11 0.44 0.09 0.00 0.00 178.44 178.02 2djv h ASP 51 N 0.13 -0.27 -1.00 -0.43 5.19 -0.81 -3.19 116.42 116.04 2djv h ASP 51 Ca 0.48 -0.26 0.36 0.00 -0.62 0.00 0.00 57.03 56.99 2djv h ASP 51 Cb 0.89 0.07 -0.16 0.00 0.18 0.00 0.00 39.33 40.31 2djv h ASP 51 CO -0.69 0.19 0.53 -0.07 -3.12 0.00 0.00 179.24 176.08 2djv h LEU 52 N -0.80 0.39 -0.90 1.55 3.38 -0.08 0.67 115.31 119.51 2djv h LEU 52 Ca -0.03 0.22 0.21 0.00 0.09 0.00 0.00 57.88 58.37 2djv h LEU 52 Cb 0.51 0.21 -0.12 0.00 0.09 0.00 0.00 40.66 41.35 2djv h LEU 52 CO 0.05 -0.28 0.43 0.11 0.09 0.00 0.00 178.44 178.85 2djv h LYS 53 N 0.17 0.45 0.10 1.13 1.57 -1.13 0.38 116.57 119.24 2djv h LYS 53 Ca 0.78 -0.03 -0.28 0.00 -1.87 0.00 0.00 60.65 59.25 2djv h LYS 53 Cb 1.91 -0.10 0.02 0.00 0.08 0.00 0.00 32.23 34.13 2djv h LYS 53 CO -0.69 0.30 -1.18 1.57 -0.57 0.00 0.00 179.45 178.88 2djv h LYS 54 N 0.47 0.51 -0.10 3.15 2.10 0.19 -3.09 116.57 119.80 2djv h LYS 54 Ca 0.56 -0.68 0.03 0.00 -2.00 0.00 0.00 60.65 58.56 2djv h LYS 54 Cb 1.01 0.22 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2djv h LYS 54 CO -0.49 1.29 0.10 1.96 -2.00 0.00 0.00 179.45 180.31 2djv h GLN 55 N 0.23 0.00 0.03 0.07 4.20 -0.38 0.16 115.11 119.42 2djv h GLN 55 Ca -0.16 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 2djv h GLN 55 Cb 1.85 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.63 2djv h GLN 55 CO 0.22 0.00 -0.01 1.25 -0.67 0.00 0.00 178.83 179.61 2djv h LEU 56 N 0.00 -0.03 -0.21 1.46 7.12 -1.12 -3.03 115.31 119.50 2djv h LEU 56 Ca 0.05 0.00 0.05 0.00 0.13 0.00 0.00 57.88 58.11 2djv h LEU 56 Cb 0.25 0.01 -0.05 0.00 -0.53 0.00 0.00 40.66 40.34 2djv h LEU 56 CO -0.00 0.33 -0.09 0.00 -0.13 0.00 0.00 178.44 178.55 2djv h ALA 57 N -1.28 0.09 -0.57 1.25 0.00 -1.45 -2.30 119.26 115.00 2djv h ALA 57 Ca -0.00 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.09 2djv h ALA 57 Cb 0.03 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 17.96 2djv h ALA 57 CO 0.01 -0.51 0.10 -0.24 0.00 0.00 0.00 179.25 178.60 2djv h VAL 58 N -0.06 0.64 -0.77 0.00 3.04 -0.67 -0.44 116.25 117.98 2djv h VAL 58 Ca 0.11 -0.08 0.18 0.00 -1.01 0.00 0.00 66.70 65.90 2djv h VAL 58 Cb 0.23 0.39 -0.12 0.00 -2.01 0.00 0.00 31.29 29.78 2djv h VAL 58 CO -0.25 0.04 0.16 0.00 -1.01 0.00 0.00 177.57 176.51 2djv h ALA 59 N 1.46 0.99 -0.19 3.17 0.00 -1.28 0.47 119.26 123.89 2djv h ALA 59 Ca 0.30 0.19 -0.19 0.00 0.00 0.00 0.00 54.91 55.21 2djv h ALA 59 Cb 0.44 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2djv h ALA 59 CO -0.40 -0.38 -0.64 0.93 0.00 0.00 0.00 179.25 178.76 2djv h GLU 60 N 0.23 0.67 0.00 0.00 5.08 -1.09 -3.48 114.58 115.99 2djv h GLU 60 Ca 0.45 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2djv h GLU 60 Cb 0.80 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2djv h GLU 60 CO -0.57 1.09 0.00 0.41 -1.00 0.00 0.00 179.01 178.94 2djv n GLY 61 N 0.44 1.38 3.76 -3.84 0.00 0.16 -5.12 105.19 101.97 2djv n GLY 61 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 2djv n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2djv s LYS 62 N 0.00 3.78 0.51 1.61 3.01 -0.98 -4.88 119.74 122.79 2djv s LYS 62 Ca 0.00 2.12 -0.21 0.00 -1.01 0.00 0.00 55.97 56.87 2djv s LYS 62 Cb 0.00 -2.61 -0.07 0.00 -1.01 0.00 0.00 37.83 34.15 2djv s LYS 62 CO 0.00 -0.63 1.14 -1.25 0.51 0.00 0.00 175.35 175.12 2djv s PRO 63 N -2.44 3.53 0.47 -1.68 0.04 -1.26 -3.30 135.00 130.36 2djv s PRO 63 Ca 0.61 1.68 -0.08 0.00 0.04 0.00 0.00 61.00 63.25 2djv s PRO 63 Cb -0.37 -2.18 0.12 0.00 0.04 0.00 0.00 34.50 32.11 2djv s PRO 63 CO 0.47 -0.72 0.41 -0.35 0.04 0.00 0.00 177.00 176.85 2djv n PRO 64 N -0.95 -1.84 -0.39 0.56 -0.04 -1.26 -4.84 135.00 126.25 2djv n PRO 64 Ca 0.10 -0.66 0.35 0.00 -0.04 0.00 0.00 63.50 63.25 2djv n PRO 64 Cb 0.50 -0.62 0.69 0.00 -0.04 0.00 0.00 33.50 34.03 2djv n PRO 64 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2djv h GLU 65 N 0.00 0.10 -6.27 0.54 4.39 -1.96 -3.45 114.58 107.92 2djv h GLU 65 Ca -0.16 -0.01 -0.45 0.00 0.34 0.00 0.00 59.36 59.09 2djv h GLU 65 Cb 0.48 -0.02 0.02 0.00 -0.10 0.00 0.00 28.75 29.13 2djv h GLU 65 CO 0.10 0.06 -0.88 0.00 -1.16 0.00 0.00 179.01 177.13 2djv n ALA 66 N -2.69 -2.16 -0.00 3.43 0.00 -1.26 -4.91 120.51 112.91 2djv n ALA 66 Ca 0.29 -0.22 -0.13 0.00 0.00 0.00 0.00 53.44 53.38 2djv n ALA 66 Cb 1.29 -2.40 -0.10 0.00 0.00 0.00 0.00 19.45 18.24 2djv n ALA 66 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2djv h PRO 67 N -1.84 -0.03 -1.30 0.00 0.13 -2.03 -3.48 132.00 123.44 2djv h PRO 67 Ca -0.63 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 64.64 2djv h PRO 67 Cb 1.36 0.01 -0.29 0.00 0.13 0.00 0.00 31.00 32.21 2djv h PRO 67 CO 0.56 0.44 0.70 0.21 -0.23 0.00 0.00 178.00 179.69 2djv s LYS 68 N -4.23 0.27 -0.72 0.86 2.20 -1.26 -5.09 119.74 111.77 2djv s LYS 68 Ca -0.16 0.26 -0.26 0.00 -0.36 0.00 0.00 55.97 55.46 2djv s LYS 68 Cb 0.02 0.13 -0.14 0.00 -1.51 0.00 0.00 37.83 36.32 2djv s LYS 68 CO 0.66 -0.04 2.47 0.41 -0.36 0.00 0.00 175.35 178.49 2djv n GLY 69 N 1.65 -0.11 3.34 5.54 0.00 -1.26 -4.90 105.19 109.45 2djv n GLY 69 Ca -0.10 0.68 -0.27 0.00 0.00 0.00 0.00 46.02 46.33 2djv n GLY 69 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2djv s LYS 70 N 8.48 1.34 -0.34 1.61 2.47 -1.26 -5.06 119.74 126.97 2djv s LYS 70 Ca 1.10 -1.24 -0.36 0.00 -1.56 0.00 0.00 55.97 53.92 2djv s LYS 70 Cb -0.52 -1.71 -0.12 0.00 -1.46 0.00 0.00 37.83 34.03 2djv s LYS 70 CO 0.32 0.41 2.15 1.63 0.16 0.00 0.00 175.35 180.02 2djv n LYS 71 N 1.10 1.07 -3.67 4.03 5.02 -1.26 -4.91 118.16 119.55 2djv n LYS 71 Ca -0.18 0.30 -0.11 0.00 -2.02 0.00 0.00 58.31 56.30 2djv n LYS 71 Cb 0.53 -2.41 -0.08 0.00 -0.02 0.00 0.00 35.03 33.05 2djv n LYS 71 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2djv s LYS 72 N 5.97 0.64 0.05 1.97 0.00 -1.26 -5.13 119.74 121.99 2djv s LYS 72 Ca 1.09 0.92 -0.28 0.00 0.00 0.00 0.00 55.97 57.70 2djv s LYS 72 Cb -0.89 0.22 -0.15 0.00 0.00 0.00 0.00 37.83 37.02 2djv s LYS 72 CO 0.51 -0.11 0.68 0.36 0.00 0.00 0.00 175.35 176.79 2djv n LYS 73 N 3.41 0.00 -2.94 1.78 2.85 -1.26 -4.93 118.16 117.07 2djv n LYS 73 Ca -0.17 0.00 -0.20 0.00 -1.05 0.00 0.00 58.31 56.89 2djv n LYS 73 Cb 0.57 -1.02 0.02 0.00 -0.65 0.00 0.00 35.03 33.94 2djv n LYS 73 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2djv s SER 74 N -0.27 5.59 -0.36 -5.58 0.01 -1.26 -5.09 113.70 106.75 2djv s SER 74 Ca 0.63 -0.13 -0.04 0.00 1.31 0.00 0.00 55.95 57.73 2djv s SER 74 Cb -0.89 -0.96 0.23 0.00 0.21 0.00 0.00 66.02 64.61 2djv s SER 74 CO 0.44 -0.84 1.11 0.61 0.41 0.00 0.00 173.24 174.96 2djv n GLY 75 N -2.03 -1.54 0.00 3.44 0.00 -1.26 -5.00 105.19 98.80 2djv n GLY 75 Ca 0.06 1.08 0.08 0.00 0.00 0.00 0.00 46.02 47.23 2djv n GLY 75 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2djv n PRO 76 N 2.22 0.39 -1.47 1.61 -0.04 -1.26 -4.57 135.00 131.88 2djv n PRO 76 Ca 0.09 0.05 -0.45 0.00 -0.04 0.00 0.00 63.50 63.15 2djv n PRO 76 Cb 0.66 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.52 2djv n PRO 76 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2djv n SER 77 N -1.10 1.33 -4.34 3.54 2.88 -1.26 -1.42 113.62 113.25 2djv n SER 77 Ca 0.10 0.14 -0.38 0.00 -1.33 0.00 0.00 58.87 57.40 2djv n SER 77 Cb 0.08 -1.17 -0.08 0.00 -0.75 0.00 0.00 64.21 62.29 2djv n SER 77 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2djv n SER 78 N 11.26 -1.13 -0.22 -3.46 3.41 -1.26 -5.23 113.62 116.99 2djv n SER 78 Ca 0.51 -1.18 0.03 0.00 -0.26 0.00 0.00 58.87 57.96 2djv n SER 78 Cb 0.20 -1.51 0.02 0.00 -0.26 0.00 0.00 64.21 62.67 2djv n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49